3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide
TL;DR: 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide (CAS 57289-12-0) is a chemical compound with molecular formula C8H11NOS6 and molecular weight 328.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,7-trimethyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane-1-carboxamide
Also Known As: 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide, 2,4,6,8,9,10-Hexathiatricyclo[3.3.1.1(3,7)]decane-1-carboxamide, 3,5,7-trimethyl-, trimethyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane-1-carboxamide, 2,4,6,8,9,10-Hexathiatricyclo[3.3.1.13,7]decane-1-carboxamide, 3,5,7-trimethyl-, 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.1~3,7~]decane-1-carboxamide
| Molecular Formula | C8H11NOS6 |
|---|---|
| Molecular Weight | 328.92 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.9165 |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 57289-12-0 |
|---|---|
| SMILES | CC12SC3(SC(S1)(SC(S2)(S3)C(=O)N)C)C |
| InChIKey | UTTRAKZKLAFKBZ-UHFFFAOYSA-N |
Product Overview
3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide (CAS 57289-12-0), with molecular formula C8H11NOS6 and molecular weight 328.92 g/mol. IUPAC: 3,5,7-trimethyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane-1-carboxamide.
Chemical Property Profile of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide
Property Insights of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide
The XLogP value of 3.8 indicates that 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 195.0 Ų indicates high polarity, suggesting 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide?
The CAS number of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide is 57289-12-0.
What is the molecular formula of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide?
The molecular formula of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide is C8H11NOS6.
What is the molecular weight of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide?
The molecular weight of 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide is 328.92 g/mol.
Where can I buy 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide?
You can request a quote for 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5,7-Trimethyl-2,4,6,8,9,10-hexathiaadamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.